Model name: model_name=EAM_Dynamo_BonnyPasianotMalerba_2009_FeNi__MO_267721408934_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.520000994205475
cohesive_energy=4.414156524791696
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -0.0364522165523 eV

========================================
theta = 0.0
========================================

Energy: 0.0203727461372492
Energy: 0.4742283725906431
Energy: 0.47422837258911854
Energy: 0.0203727461372492
Energy: 0.4742283725906431
Energy: 0.47422837258911854
Energy: 0.0203727461372492
Energy: 0.4742283725906431
Energy: 0.47422837258911854
Energy: 0.0203727461372492
Energy: 0.47146540322250313
Energy: 0.024302158490881406
Energy: 0.4712568544420728
Energy: 0.47146540322250313
Energy: 0.024302158490881406
Energy: 0.4712568544435975
Energy: 0.47146540322250313
Energy: 0.024302158489356816
Energy: 0.4712568544420728
Energy: 0.47146540322250313
Energy: 1.6148662113044223
Energy: 0.02062091704243771
Energy: 0.020620917040913123
Energy: 1.6216107730816658
Energy: 0.020620917040913123
Energy: 0.020620917039388533
Energy: 0.7568929404080883
Energy: 0.2585235497337783
Energy: 0.020620917040913123
Energy: 1.360503219593835
Energy: 0.47146540321945396
Energy: 0.4712568544420728
Energy: 0.024302158490881406
Energy: 0.47146540321945396
Energy: 0.4712568544420728
Energy: 0.024302158490881406
Energy: 0.47146540321945396
Energy: 0.4712568544435975
Energy: 0.024302158489356816
Energy: 0.47146540321945396
Energy: 0.0203727461372492
Energy: 0.4742283725921678
Energy: 0.4742283725906431
Energy: 0.0203727461372492
Energy: 0.4742283725921678
Energy: 0.4742283725906431
Energy: 0.0203727461372492
Energy: 0.4742283725921678
Energy: 0.4742283725906431
Energy: 0.0203727461372492
Energy: 0.47146540322250313
Energy: 0.024302158489356816
Energy: 0.47125685443902365
Energy: 0.4714654032209785
Energy: 0.024302158489356816
Energy: 0.47125685444512205
Energy: 0.47146540322250313
Energy: 0.024302158489356816
Energy: 0.4712568544405482
Energy: 0.4714654032209785
Energy: 1.6148662113028978
Energy: 0.020620917040913123
Energy: 0.020620917040913123
Energy: 1.8045250419600292
Energy: 0.020620917040913123
Energy: 0.020620917040913123
Energy: 1.6377866352067125
Energy: 0.020620917039388533
Energy: 0.020620917040913123
Energy: 0.9839360165843076

minimum gb energy = 0.0203727461372492 eV
minimum distance =  2.31790341628441 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 1.3874151874406644
Energy: 1.3426976091872853
Energy: 1.2311859609446845
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Energy: 1.2311859609334814
Energy: 1.3874151874406644
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Energy: 1.1455432132961323
Energy: 1.179988961285387
Energy: 1.3554167005501814
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Energy: 1.2993858052522578
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Energy: 1.299001585071327
Energy: 1.352855006305419
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Energy: 1.3426467676777891
Energy: 1.394806330825514
Energy: 1.0030210749459003
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Energy: 1.3419265567092398
Energy: 1.2680928229137587
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Energy: 1.3419265567092398
Energy: 1.2680928229137587
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Energy: 1.3419265567055054
Energy: 1.0461912437300191
Energy: 1.2448534500548931
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Energy: 1.342618593698775
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Energy: 1.3929695064636616
Energy: 1.3532765826887994
Energy: 1.1605687247178271
Energy: 1.009484976399483
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Energy: 1.0094849810319124
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Energy: 1.0094849979862992
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Energy: 0.9607418478739835
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Energy: 1.333604999657517
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Energy: 1.3336049996537824
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Energy: 1.2305209247918996
Energy: 1.333604999657517
Energy: 0.9607418478739835
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Energy: 1.0028807683606482
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Energy: 1.4329984336380965
Energy: 1.3424225791781421
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Energy: 1.3797960544337966
Energy: 1.1567671382978124
Energy: 1.1606301310605218
Energy: 1.3797949439323012
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Energy: 1.3797954281851332
Energy: 1.1567312039064455
Energy: 1.1606301310567873
Energy: 1.046636894801142
Energy: 1.4130958217848162
Energy: 1.179395413089022
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Energy: 1.179395413089022
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Energy: 1.4130958217848162
Energy: 1.179395413089022
Energy: 1.0466368948048763
Energy: 1.1570021939361186
Energy: 1.3874151874406644
Energy: 1.342697609183551
Energy: 1.1570021939323842
Energy: 1.3874151874369298
Energy: 1.3426976091872853
Energy: 1.1570021939361186
Energy: 1.3874151874406644
Energy: 1.3426976091910199
Energy: 1.1570021939361186
Energy: 1.1455432132961323
Energy: 1.1799889612816528
Energy: 1.3554167005501814
Energy: 1.1455432132961323
Energy: 1.1799889612779182
Energy: 1.355416700553916
Energy: 1.1455432132961323
Energy: 1.1799889612816528
Energy: 1.3554167005501814
Energy: 1.1455432132961323
Energy: 1.070461801100177
Energy: 1.2993958005237434
Energy: 1.3528550063128881
Energy: 1.0704618011039115
Energy: 1.2993841477382708
Energy: 1.3528550063128881
Energy: 1.0704618011039115
Energy: 1.2990028044960604
Energy: 1.3528550063166223
Energy: 1.070461801100177
Energy: 1.3426467676777891
Energy: 1.3948063308292487
Energy: 1.0030210749421657
Energy: 1.3426467676815235
Energy: 1.3948063308329832
Energy: 1.003021074934697
Energy: 1.3426467676777891
Energy: 1.3948063308292487
Energy: 1.0030210749421657
Energy: 1.3426467676740546

minimum gb energy = 0.9605895163351916 eV
minimum distance =  2.3313937360552 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

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Energy: 1.068500502341246
Energy: 1.0681777153746252
Energy: 1.2460624386599088
Energy: 1.0685005023376015
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minimum gb energy = 1.0643657287362374 eV
minimum distance =  2.22821888738365 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 1.2302190703516993
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Energy: 1.345125575360813
Energy: 1.2201934971541097
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Energy: 1.1768941953669785
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Energy: 1.217104732892834
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Energy: 1.282153201730311
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Energy: 1.3107242363882585
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Energy: 1.260269219919308
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Energy: 1.2960185450988095
Energy: 1.271533632679956
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Energy: 1.1868191701929165
Energy: 1.2650043626692298
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Energy: 1.3923936308478406
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Energy: 1.2390574881931316
Energy: 1.3008652028010632
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Energy: 1.2390574881931316
Energy: 1.3008652028010632
Energy: 1.2920384365598836
Energy: 1.2483504648952268
Energy: 1.2660132707525535
Energy: 1.2631165818263566
Energy: 1.2483504648911152
Energy: 1.266013270748442
Energy: 1.2631165818284125
Energy: 1.2483504648911152
Energy: 1.266013270748442
Energy: 1.2631165818201893
Energy: 1.2483504648952268
Energy: 1.2837595267027184
Energy: 1.304246536580913
Energy: 1.3059616168886021
Energy: 1.283759526704774
Energy: 1.304227726896653
Energy: 1.3059616168886021
Energy: 1.2837595267068296
Energy: 1.3042465365850247
Energy: 1.3059616168865464
Energy: 1.283759526704774
Energy: 1.362876743923447
Energy: 1.3052985588511985
Energy: 1.2520512486717625
Energy: 1.3628767439213911
Energy: 1.3053240626020415
Energy: 1.252051248673818
Energy: 1.362876743923447
Energy: 1.3052985588532542
Energy: 1.2520512486697066
Energy: 1.362876743923447
Energy: 1.2976654468321047
Energy: 1.3150025202138416
Energy: 1.2282507297065122
Energy: 1.2976654468321047
Energy: 1.3150025202138416
Energy: 1.2282507297065122
Energy: 1.2976654468341604
Energy: 1.3150025202158975
Energy: 1.2282507297024006
Energy: 1.2976654468279931
Energy: 1.2286331656686802
Energy: 1.3827818310379514
Energy: 1.256964060547126
Energy: 1.2286331656686802
Energy: 1.3826413526299624
Energy: 1.2569640605450703
Energy: 1.2286331656666245
Energy: 1.3827818310358955
Energy: 1.2569640605491819
Energy: 1.2286331656666245
Energy: 1.2151051137484514
Energy: 1.2301051279314275
Energy: 1.3107802506544957
Energy: 1.2151051137484514
Energy: 1.2296836926417514
Energy: 1.3107802506565513
Energy: 1.215105113746433
Energy: 1.2301051279334831
Energy: 1.3107802506524397
Energy: 1.2151051137443771
Energy: 1.2529300786783328
Energy: 1.229136275246627
Energy: 1.363082339094612
Energy: 1.2529300786742215
Energy: 1.2292845211555556
Energy: 1.363082339094612
Energy: 1.2529300786762774
Energy: 1.2291362752486827
Energy: 1.3630823390925564
Energy: 1.2529300786845003

minimum gb energy = 1.176894195364923 eV
minimum distance =  2.28830061935826 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.1540613114253349
Energy: 1.2535199523819938
Energy: 1.2533192600783478
Energy: 1.154061311423923
Energy: 1.2535199523798768
Energy: 1.2533192600783478
Energy: 1.1540613114253349
Energy: 1.2535199523819938
Energy: 1.253319260077642
Energy: 1.154061311423923
Energy: 1.153882215048449
Energy: 1.1734341714487424
Energy: 1.2123527528957458
Energy: 1.153882215048449
Energy: 1.1734341714487424
Energy: 1.2123527528915115
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Energy: 1.1734341714487424
Energy: 1.2123527528943348
Energy: 1.1538822150477432
Energy: 1.243430458642629
Energy: 1.3213263993818483
Energy: 1.1355749553509662
Energy: 1.2434304586419231
Energy: 1.3213263993867888
Energy: 1.1355749794260446
Energy: 1.243430458642629
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Energy: 1.1731174418322756
Energy: 1.3391583449192872
Energy: 1.2527530534260034
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Energy: 1.2534868555022833
Energy: 1.3109614700750993
Energy: 1.2527530534252977
Energy: 1.253486855501578
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Energy: 1.252753053427415
Energy: 1.1733885387747796
Energy: 1.2532270008853128
Energy: 1.2928740420038092
Energy: 1.1733885387733682
Energy: 1.2532270008824902
Energy: 1.2928740420059266
Energy: 1.173388538776191
Energy: 1.2532270008853128
Energy: 1.2928740420038092
Energy: 1.1733885387733682
Energy: 1.236489913061744
Energy: 1.2436700659713298
Energy: 1.2902627715972272
Energy: 1.2364899130659783
Energy: 1.2436700659713298
Energy: 1.2902627715936985
Energy: 1.2364899130624496
Energy: 1.2436700659727415
Energy: 1.2902627715972272
Energy: 1.2364899130645668
Energy: 1.2531279839515594
Energy: 1.169797555453815
Energy: 1.1557878283282692
Energy: 1.2531279839508536
Energy: 1.1697975554552267
Energy: 1.155787828326152
Energy: 1.2531279839508536
Energy: 1.1697975554545208
Energy: 1.1557878283282692
Energy: 1.2531279839508536
Energy: 1.2431692650599417
Energy: 1.1355045293452373
Energy: 1.3214590688921124
Energy: 1.2431692650578245
Energy: 1.1355045295082005
Energy: 1.3214590688907009
Energy: 1.2431692650599417
Energy: 1.1355045294947914
Energy: 1.3214590688871721
Energy: 1.2431692650571189
Energy: 1.1539346230171723
Energy: 1.212096957055393
Energy: 1.1735079102909847
Energy: 1.1539346230199952
Energy: 1.2120969570539817
Energy: 1.1735079102923962
Energy: 1.153934623015055
Energy: 1.2120969570596276
Energy: 1.173507910290279
Energy: 1.1539346230185836
Energy: 1.1540613114253349
Energy: 1.2535199523798768
Energy: 1.2533192600797591
Energy: 1.1540613114253349
Energy: 1.2535199523798768
Energy: 1.2533192600797591
Energy: 1.1540613114253349
Energy: 1.2535199523805824
Energy: 1.2533192600769363
Energy: 1.1540613114253349

minimum gb energy = 1.1355045293452373 eV
minimum distance =  2.30609355040476 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 1.2905322471274498
Energy: 1.1705525420998475
Energy: 1.1702539850303566
Energy: 1.251873818071308
Energy: 1.1705525421135388
Energy: 1.1702539850303566
Energy: 1.2905322471274498
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Energy: 1.1544038760067854
Energy: 1.043590560447726
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Energy: 1.154403876001309
Energy: 1.1897329157013017
Energy: 1.0320473627275895
Energy: 1.070284672253632
Energy: 1.0629560443007693
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Energy: 1.0702681953815847
Energy: 1.210576715568257
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Energy: 1.070284672245467
Energy: 1.2098682610799476
Energy: 1.0579985013103004
Energy: 1.057707073315797
Energy: 1.0652845173642707
Energy: 1.0579985013075621
Energy: 1.057707073315797
Energy: 1.0691630529718923
Energy: 1.057998501315777
Energy: 1.057707073315797
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Energy: 1.0579985013130389
Energy: 1.0853503011380796
Energy: 1.2737879401678056
Energy: 1.0653334090110564
Energy: 1.0853503011271266
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Energy: 1.1949644172589624
Energy: 1.1207885649213534
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Energy: 1.194964417264439
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Energy: 1.031512265249116
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Energy: 1.266310672445255
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Energy: 1.068180213937418
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Energy: 1.259844481835972
Energy: 1.0630172916929999
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Energy: 1.0322908137750917
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Energy: 1.0664507641267638
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Energy: 1.1367801531654986
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Energy: 1.1367801531709751
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Energy: 1.1061993745034775
Energy: 1.2913181609527364
Energy: 1.195393677881478
Energy: 1.1206596560214253
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Energy: 1.1206596560214253
Energy: 1.2553304476978482
Energy: 1.1967032929597854
Energy: 1.0309564344974647
Energy: 1.141162619570344
Energy: 1.1967032929570474
Energy: 1.030956434500203
Energy: 1.1411626195676057
Energy: 1.196703292954309
Energy: 1.0309564344974647
Energy: 1.1411626195676057
Energy: 1.1967032929570474
Energy: 1.1361607986422184
Energy: 1.0453351338854895
Energy: 1.0489538046909872
Energy: 1.1361607986449564
Energy: 1.0453351338717982
Energy: 1.0488533918314196
Energy: 1.1361607986449564
Energy: 1.0453351338772745
Energy: 1.0489538046909872
Energy: 1.136160798650433
Energy: 1.1333455577854192
Energy: 1.247587941446239
Energy: 1.0580167977574604
Energy: 1.133345557782681
Energy: 1.2475879414517155
Energy: 1.0579733918133012
Energy: 1.1333455577799427
Energy: 1.2475879414435005
Energy: 1.0580167977574604
Energy: 1.1333455577908957
Energy: 1.0703160732866472
Energy: 1.341342512513978
Energy: 1.085120718252806
Energy: 1.0703160732893855
Energy: 1.3413425125085017
Energy: 1.085120718252806
Energy: 1.0703160732948622
Energy: 1.3413425125085017
Energy: 1.085120718252806
Energy: 1.0703160732866472
Energy: 1.0752401512114746
Energy: 1.0622103662676823
Energy: 1.061980065835998
Energy: 1.075240151225166
Energy: 1.0622103662512528
Energy: 1.0619800658387364
Energy: 1.075240151216951
Energy: 1.0622103662567293
Energy: 1.0619800658414746
Energy: 1.0752401512142127
Energy: 1.0650447573115835
Energy: 1.1335918060054881
Energy: 1.1390067961341663
Energy: 1.0650447573115835
Energy: 1.1335918059945849
Energy: 1.1390067961341663
Energy: 1.0650447573088453
Energy: 1.1335918060054881
Energy: 1.1390067961423813
Energy: 1.0650447573115835
Energy: 1.1828561866709504
Energy: 1.0384790318638468
Energy: 1.1290223300962372
Energy: 1.1828561866736886
Energy: 1.038479031869323
Energy: 1.1290223301099285
Energy: 1.1828561866709504
Energy: 1.0384790318720614
Energy: 1.1290223301017137
Energy: 1.1828561866791651
Energy: 1.1791395865053516
Energy: 1.1711505892794445
Energy: 1.2523724414971653
Energy: 1.179139586513566
Energy: 1.1711505892794445
Energy: 1.2523724414971653
Energy: 1.1791395865080898
Energy: 1.1711505892821825
Energy: 1.252372441502642
Energy: 1.1791395865163043
Energy: 1.0300600001930054
Energy: 1.239106591552079
Energy: 1.0987907742211862
Energy: 1.030060000190267
Energy: 1.239071162281774
Energy: 1.0987907742211862
Energy: 1.0300600001930054
Energy: 1.239106591552079
Energy: 1.0987907742157095
Energy: 1.0300600001875289
Energy: 1.0354447263399569
Energy: 1.0656022420359201
Energy: 1.0683121730550942
Energy: 1.0354447263426951
Energy: 1.0655794795576898
Energy: 1.0682569387242113
Energy: 1.035444726353648
Energy: 1.0656022420496114
Energy: 1.0683121730550942
Energy: 1.0354447263481716
Energy: 1.0460851399580378
Energy: 1.069761467851506
Energy: 1.0583475028663538
Energy: 1.0460851399635143
Energy: 1.069757186874672
Energy: 1.0583475028663538
Energy: 1.0460851399635143
Energy: 1.069761467851506
Energy: 1.0583475028636156
Energy: 1.0460851399635143
Energy: 1.2416222620451918
Energy: 1.0636688468911761
Energy: 1.1268253916867816
Energy: 1.24162226204793
Energy: 1.0636688705719228
Energy: 1.1268253916813051
Energy: 1.24162226204793
Energy: 1.0636688468884379
Energy: 1.1268253916840434
Energy: 1.2416222620397153
Energy: 1.1044238175450343
Energy: 1.1790692273567727
Energy: 1.0498534869892444
Energy: 1.1044238175450343
Energy: 1.1790692273595111
Energy: 1.049853486983768
Energy: 1.1044238175477723
Energy: 1.1790692273649876
Energy: 1.0498534869919827
Energy: 1.1044238175505106

minimum gb energy = 1.0299143575869207 eV
minimum distance =  2.2642116817033 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 1.0067445346378607
Energy: 0.5791465933397965
Energy: 0.5791532687211993
Energy: 0.6412129064963628
Energy: 0.5791465933417467
Energy: 0.579153268718599
Energy: 1.0067445346398112
Energy: 0.5791465933397965
Energy: 0.5791532687205493
Energy: 0.6412129064963628
Energy: 0.8881095483847409
Energy: 0.567071136843174
Energy: 0.6994124503744574
Energy: 0.8664808732928452
Energy: 0.5670711368438242
Energy: 0.8078538196477635
Energy: 0.8881095483850956
Energy: 0.5670711368392736
Energy: 0.6994124503731572
Energy: 0.8664808732973959
Energy: 0.640111988841173
Energy: 0.6203007949894401
Energy: 0.8116422689362307
Energy: 0.8560205144680765
Energy: 0.6203007949894401
Energy: 0.6390104987587751
Energy: 0.6401119888401685
Energy: 0.6203007949894401
Energy: 0.811642268943027
Energy: 0.8560205144700268
Energy: 0.9020980078942615
Energy: 0.5798374846642744
Energy: 0.8219248203548853
Energy: 0.9020980078936113
Energy: 0.5798374846662246
Energy: 0.8220532149414825
Energy: 0.9020980078965664
Energy: 0.5798374846678795
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Energy: 0.9020980078936113
Energy: 0.579320507549865
Energy: 0.5687128583542651
Energy: 0.6592822904332691
Energy: 0.5793205075469691
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Energy: 0.7022238167797228
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Energy: 0.5687128583516647
Energy: 0.6592822904309641
Energy: 0.5793205075528199
Energy: 0.903888472056815
Energy: 0.7002873746516282
Energy: 0.779371368783992
Energy: 0.9038884720594152
Energy: 0.7095194581259477
Energy: 0.7855566241103932
Energy: 0.9038884720630203
Energy: 0.7002873747062354
Energy: 0.7793713687794415
Energy: 0.9038884720613656
Energy: 0.5786846807152913
Energy: 0.7849646542704789
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Energy: 0.784964654268824
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Energy: 0.5786846807172416
Energy: 0.9007027439096567
Energy: 0.708662190720507
Energy: 0.6110349621239751
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Energy: 0.7574672227131082
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Energy: 0.9007027439100114
Energy: 0.708662190714006
Energy: 0.6110349621220248
Energy: 0.9007027439129072
Energy: 0.6404089152787531
Energy: 0.8671594484611564
Energy: 0.5790652648583497
Energy: 0.6828940182838508
Energy: 0.8375141079536228
Energy: 0.5790652648576997
Energy: 0.6404089152817081
Energy: 0.8671594484549511
Energy: 0.5790652648606547
Energy: 0.6828940182838508
Energy: 0.7030367150362817
Energy: 0.6897525383430732
Energy: 0.5673084473520704
Energy: 0.5966500994244255
Energy: 0.6074468703696833
Energy: 0.5673084473550254
Energy: 0.7030367150401823
Energy: 0.6897525383511698
Energy: 0.5673084473527206
Energy: 0.5966500994182792
Energy: 0.7666849839319048
Energy: 0.8749051615378415
Energy: 0.5693860307945149
Energy: 0.8027997138198713
Energy: 0.8749051615420965
Energy: 0.5693860307935101
Energy: 0.7666849839377556
Energy: 0.8749051615375459
Energy: 0.5693860307899642
Energy: 0.8027997138257219
Energy: 0.5435025384803072
Energy: 0.5791465933378462
Energy: 0.5791532687153484
Energy: 0.6502556511233525
Energy: 0.5791465933407421
Energy: 0.5791532687159986
Energy: 0.5435025384865125
Energy: 0.5791465933387918
Energy: 0.5791532687198991
Energy: 0.6502556511240026
Energy: 0.8043908415509413
Energy: 0.5670711368412239
Energy: 0.8462618106623071
Energy: 0.7620259622789108
Energy: 0.5670711368464245
Energy: 0.697890283056382
Energy: 0.8043908415525962
Energy: 0.5670711368428786
Energy: 0.8462618106600615
Energy: 0.7620259622798565
Energy: 0.7031039032088261
Energy: 0.6203007949907402
Energy: 0.6096887586266626
Energy: 0.5967224624481013
Energy: 0.6203007949913903
Energy: 0.69250303652607
Energy: 0.7031039032107763
Energy: 0.6203007949910948
Energy: 0.6096887586263672
Energy: 0.5967224624496971
Energy: 0.902098007893966
Energy: 0.5798374846652791
Energy: 0.8153223867402464
Energy: 0.9020980078959163
Energy: 0.5798374846649246
Energy: 0.7851075534639275
Energy: 0.9020980078952663
Energy: 0.5798374846649246
Energy: 0.8153223867372915
Energy: 0.9020980078942615
Energy: 0.57932050755347
Energy: 0.5687128583549151
Energy: 0.7572236803337711
Energy: 0.5793205075466736
Energy: 0.5687128583539105
Energy: 0.7084276686580671
Energy: 0.5793205075453736
Energy: 0.5687128583542651
Energy: 0.7572236803279202
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Energy: 0.903888472056815
Energy: 0.792793589959411
Energy: 0.7855760907271147
Energy: 0.9038884720613656
Energy: 0.6964801674556073
Energy: 0.8585077872211992
Energy: 0.9038884720649706
Energy: 0.7927935899542101
Energy: 0.785576090725519
Energy: 0.90388847206042
Energy: 0.5786846807172416
Energy: 0.8576113433268262
Energy: 0.9435322733844023
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Energy: 0.784964654268174
Energy: 0.9435322733805017
Energy: 0.5786846807168868
Energy: 0.8576113433274763
Energy: 0.9435322733782562
Energy: 0.5786846807181871
Energy: 0.9007027439064064
Energy: 0.7021567727904643
Energy: 0.6110349621256298
Energy: 0.9007027439109568
Energy: 0.6595471113167082
Energy: 0.6110349621217293
Energy: 0.9007027439116069
Energy: 0.7021567727891642
Energy: 0.6110349621223794
Energy: 0.9007027439113116
Energy: 0.6590091271316756
Energy: 0.8747471710437761
Energy: 0.5790652648576997
Energy: 0.5888241125808696
Energy: 0.9103424772303886
Energy: 0.5790652648550993
Energy: 0.6590091271362262
Energy: 0.8747471710424759
Energy: 0.5790652648580543
Energy: 0.5888241125815197
Energy: 0.6402024799019751
Energy: 0.6399732536803515
Energy: 0.5673084473504748
Energy: 0.8558703540057441
Energy: 0.8082196965245965
Energy: 0.5673084473520704
Energy: 0.640202479906821
Energy: 0.6399732536794059
Energy: 0.5673084473530752
Energy: 0.8558703540070443
Energy: 0.9115035473765057
Energy: 0.8749051615384915
Energy: 0.5693860307948103
Energy: 0.8797668095302602
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Energy: 0.8797668095315603
Energy: 1.0067445346382153
Energy: 0.5791465933391463
Energy: 0.5791532687175943
Energy: 0.6412129064966583
Energy: 0.5791465933417467
Energy: 0.5791532687146984
Energy: 1.0067445346365607
Energy: 0.5791465933407421
Energy: 0.5791532687195446
Energy: 0.6412129064966583
Energy: 0.8881095483866912
Energy: 0.5670711368412239
Energy: 0.6994124503751075
Energy: 0.8664808732963912
Energy: 0.5670711368441786
Energy: 0.8078538196464633
Energy: 0.888109548385391
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Energy: 0.6994124503728618
Energy: 0.8664808732937909
Energy: 0.6401119888414686
Energy: 0.6203007949884946
Energy: 0.8116422689384765
Energy: 0.8560205144677219
Energy: 0.6203007949894401
Energy: 0.6390104987564703
Energy: 0.640111988841173
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Energy: 0.811642268941727
Energy: 0.8560205144680765
Energy: 0.9020980078946161
Energy: 0.5798374846649246
Energy: 0.8219248203526397
Energy: 0.9020980078952663
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Energy: 0.8220532149421326
Energy: 0.902098007893966
Energy: 0.5798374846685295
Energy: 0.8219248203577812
Energy: 0.902098007893316
Energy: 0.579320507549865
Energy: 0.5687128583549151
Energy: 0.6592822904309641
Energy: 0.579320507546319
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Energy: 0.7022238167826187
Energy: 0.5793205075495695
Energy: 0.5687128583552107
Energy: 0.6592822904309641
Energy: 0.5793205075524652
Energy: 0.9038884720542146
Energy: 0.7002873746581291
Energy: 0.7793713687865925
Energy: 0.9038884720594152
Energy: 0.7095194581278979
Energy: 0.7855566241093884
Energy: 0.9038884720633158
Energy: 0.7002873747169321
Energy: 0.7793713687813918
Energy: 0.9038884720623702
Energy: 0.5786846807159414
Energy: 0.7849646542691787
Energy: 0.9435322733847569
Energy: 0.5786846807172416
Energy: 0.8214610007652811
Energy: 0.9435322733844023
Energy: 0.5786846807159414
Energy: 0.7849646542717791
Energy: 0.9435322733805017
Energy: 0.5786846807181871
Energy: 0.9007027439096567
Energy: 0.7086621907221026
Energy: 0.6110349621281711
Energy: 0.9007027439119616
Energy: 0.7574672227137582
Energy: 0.6110349621230295
Energy: 0.9007027439113116
Energy: 0.708662190713356
Energy: 0.6110349621207247
Energy: 0.9007027439139119
Energy: 0.6404089152781031
Energy: 0.8671594484601519
Energy: 0.5790652648563995
Energy: 0.6828940182854464
Energy: 0.8375141079513772
Energy: 0.5790652648574042
Energy: 0.6404089152833038
Energy: 0.8671594484562513
Energy: 0.5790652648603
Energy: 0.6828940182834962
Energy: 0.7030367150369318
Energy: 0.6897525383433686
Energy: 0.5673084473533706
Energy: 0.59665009942478
Energy: 0.6074468703742338
Energy: 0.5673084473533706
Energy: 0.7030367150388821
Energy: 0.6897525383482738
Energy: 0.567308447351125
Energy: 0.5966500994192248
Energy: 0.7666849839341505
Energy: 0.8749051615427468
Energy: 0.5693860307951649
Energy: 0.8027997138208759
Energy: 0.8749051615423921
Energy: 0.5693860307951649
Energy: 0.7666849839341505
Energy: 0.8749051615381961
Energy: 0.56938603079221
Energy: 0.8027997138218214

minimum gb energy = 0.5435025384803072 eV
minimum distance =  2.32251207159277 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 1.0057284908913169
Energy: 1.0515626491118357
Energy: 1.050775306729133
Energy: 0.9802028631709541
Energy: 1.0515626491189733
Energy: 1.0507753067273486
Energy: 1.0057284908895323
Energy: 1.0515626491154044
Energy: 1.050775306722028
Energy: 0.9802028631709541
Energy: 1.090744039391405
Energy: 0.9898782230333478
Energy: 1.0397906059994826
Energy: 1.0907440393931895
Energy: 0.9898782230315636
Energy: 1.039790605997698
Energy: 1.0907440393896206
Energy: 0.9898782230369166
Energy: 1.03979060600662
Energy: 1.0907440394002945
Energy: 1.0423616119705357
Energy: 0.9333553313449804
Energy: 1.0157960222398175
Energy: 1.0002185331375748
Energy: 0.9333553313431958
Energy: 1.015796022238033
Energy: 1.0138541710570987
Energy: 0.933355331339627
Energy: 1.015796022238033
Energy: 0.9959847394645575
Energy: 1.2052500345034611
Energy: 0.9787194277892466
Energy: 1.0027386885722882
Energy: 1.2052500345034611
Energy: 0.9787194277821089
Energy: 1.0027386885740726
Energy: 1.2052500345034611
Energy: 0.9787194277838934
Energy: 1.0027386885705039
Energy: 1.2052500344981076
Energy: 1.1129412061593138
Energy: 1.0363827515820128
Energy: 0.9775540773493141
Energy: 1.1129412061628827
Energy: 1.0363827515820128
Energy: 0.9775540773403922
Energy: 1.1129412061628827
Energy: 1.0363827515855815
Energy: 0.9775540773421768
Energy: 1.1129412061628827
Energy: 1.026822476385427
Energy: 1.0893884714594493
Energy: 1.0708414742301977
Energy: 1.0268224763907805
Energy: 1.0893884714612336
Energy: 1.07084147423912
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Energy: 1.0708414742373353
Energy: 1.0268224763925649
Energy: 0.973769874394998
Energy: 1.053067203810416
Energy: 1.1198317128529627
Energy: 0.9737663439376929
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Energy: 1.019805719947781
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Energy: 0.9918337532432424
Energy: 1.0198057199459967
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Energy: 1.0198057199459967
Energy: 1.05888055723931
Energy: 0.9313980095991837
Energy: 1.1409679854551324
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Energy: 0.9313980096027525
Energy: 1.1409679854515637
Energy: 1.0588805572410942
Energy: 0.9313980095973994
Energy: 1.140967985453348
Energy: 1.0588805572375255
Energy: 1.0582861898666773
Energy: 0.9902644608716097
Energy: 1.108960264640364
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Energy: 1.1089602646421484
Energy: 1.058286189870246
Energy: 0.9902644608698253
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Energy: 1.0582861898684617
Energy: 1.051506439589322
Energy: 1.0592694633164814
Energy: 1.0091564607359966
Energy: 1.0515064395821845
Energy: 1.0592694633093438
Energy: 1.0091568291230406
Energy: 1.0515064395839688
Energy: 1.0592694633111281
Energy: 1.009156460734212
Energy: 1.051506439589322
Energy: 0.9914236497895886
Energy: 1.0728705270115035
Energy: 1.084992761278116
Energy: 0.9914236497824511
Energy: 1.0724968435904545
Energy: 1.0852408295555966
Energy: 0.9914236497842355
Energy: 1.0728705270204255
Energy: 1.084992761272763
Energy: 0.9914236497931573
Energy: 0.9760613962664904
Energy: 1.0057316987029772
Energy: 1.0128405699703622
Energy: 0.976061396264706
Energy: 1.0057499432703512
Energy: 1.0128524014988995
Energy: 0.9760613962664904
Energy: 1.005731698706546
Energy: 1.0128405699757155
Energy: 0.9760613962682749
Energy: 0.9845513899257639
Energy: 1.018755967586274
Energy: 1.0099345358798746
Energy: 0.9845513899275481
Energy: 1.018755967586274
Energy: 1.00993453587809
Energy: 0.9845513899257639
Energy: 1.018755967586274
Energy: 1.00993453587809
Energy: 0.9845513899239794
Energy: 1.050961864710428
Energy: 0.9914679790182326
Energy: 1.0553497309860083
Energy: 1.0509618647157812
Energy: 0.9914679790253703
Energy: 1.0553497309895772
Energy: 1.0509618647139967
Energy: 0.9914679790253703
Energy: 1.0553497309913615
Energy: 1.0509618647050747
Energy: 1.0421880453324532
Energy: 1.0636081980991634
Energy: 0.989104596109223
Energy: 1.0421880453378067
Energy: 1.0636081980938101
Energy: 0.9891045961127916
Energy: 1.0421880453395909
Energy: 1.0636081980991634
Energy: 0.9891045961163603
Energy: 1.0421880453378067
Energy: 1.0591782790126087
Energy: 1.1426961007242569
Energy: 0.9330028901598031
Energy: 1.0591782790108246
Energy: 1.1426961007224723
Energy: 0.9330028901562344
Energy: 1.0591782790143933
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Energy: 1.0560136757102594
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Energy: 1.0129401869066466
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Energy: 1.0517148035942865
Energy: 1.0912383780728787
Energy: 1.0114606270877393
Energy: 1.051714803588933
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Energy: 0.9732391305360375
Energy: 1.0010859444246438
Energy: 1.0309055435532288
Energy: 0.9732391305378219

minimum gb energy = 0.9313980095973994 eV
minimum distance =  2.25561196488171 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

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Energy: 1.3373010353495351
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Energy: 1.3248392962858238
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Energy: 1.1797739289727964
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Energy: 1.3150904734264415
Energy: 1.1797739289716158
Energy: 1.3248392962870046
Energy: 1.3150904734252606
Energy: 1.1797739289739775
Energy: 1.2813203043793557
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Energy: 1.3386110090886962
Energy: 1.2813203043793557
Energy: 1.2981759160659219
Energy: 1.3386110090875154
Energy: 1.2813203043781745

minimum gb energy = 1.1797739289716158 eV
minimum distance =  2.28098118860991 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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Energy: 1.385658915355155
Energy: 1.3956327575618281
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minimum gb energy = 1.3530165779815424 eV
minimum distance =  2.23812250476411 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.3549117113841227
Energy: 1.4331601105017104
Energy: 1.3698851426522265
Energy: 1.369160387089637
Energy: 1.3552454020890867
Energy: 1.369885142654894
Energy: 1.369160387089637
Energy: 1.3552454020970892
Energy: 1.3698851426522265
Energy: 1.3691603870869695
Energy: 1.3552454020944216
Energy: 1.3698851426522265
Energy: 1.4567216698449714
Energy: 1.4859130934793952
Energy: 1.3398266272059973
Energy: 1.4305567692924468
Energy: 1.485913093482014
Energy: 1.3398266272059973
Energy: 1.456721669836969
Energy: 1.4859130934793952
Energy: 1.3398266272113324
Energy: 1.4305567692897794
Energy: 1.3928515858123667
Energy: 1.394101864026176
Energy: 1.4286662697640957
Energy: 1.3772558027249748
Energy: 1.3941018640288434
Energy: 1.4286662697614283
Energy: 1.3928515858123667
Energy: 1.3941018640235086
Energy: 1.4286662697587607
Energy: 1.3772558027249748
Energy: 1.43403237542877
Energy: 1.3397100192607518
Energy: 1.414544947791436
Energy: 1.4340323754207676
Energy: 1.3397100192607518
Energy: 1.4145449477887688
Energy: 1.4340323754261026
Energy: 1.3397100192607518
Energy: 1.414544947791436
Energy: 1.43403237542877
Energy: 1.3801568409402922
Energy: 1.3551919577971643
Energy: 1.3808211603823257
Energy: 1.3801568409376246
Energy: 1.355163892411262
Energy: 1.3808211603823257
Energy: 1.3801568409376246
Energy: 1.3551919577998317
Energy: 1.3808211603849931
Energy: 1.3801568409349574
Energy: 1.4293270237661087
Energy: 1.354768774249114
Energy: 1.5057379450276367
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Energy: 1.3549718886214386
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Energy: 1.4293270237607736
Energy: 1.3547687742437788
Energy: 1.5057379450302555
Energy: 1.429327023763441
Energy: 1.416750562676387
Energy: 1.3548587968649732
Energy: 1.3872891462673411
Energy: 1.416750562676387
Energy: 1.3548587968649732
Energy: 1.3872891462646737
Energy: 1.4167505626817218
Energy: 1.3548587968596384
Energy: 1.3872891462700085
Energy: 1.4167505626790544
Energy: 1.3410154834271584
Energy: 1.475169856505686
Energy: 1.443110786199935
Energy: 1.341015483424491
Energy: 1.4751698565030187
Energy: 1.4430777951933178
Energy: 1.341015483429826
Energy: 1.4751698564976836
Energy: 1.44311078620527
Energy: 1.3410154834271584
Energy: 1.3425744875477839
Energy: 1.3419373325396107
Energy: 1.4048833230779294
Energy: 1.3425744875477839
Energy: 1.3419373325369433
Energy: 1.4048833230805968
Energy: 1.3425744875477839
Energy: 1.3419373325342758
Energy: 1.4048833230779294
Energy: 1.3425744875477839
Energy: 1.4859996501019996
Energy: 1.4238707411681744
Energy: 1.3961335761835216
Energy: 1.4859996501019996
Energy: 1.3937082808461285
Energy: 1.3936816505764282
Energy: 1.4859996501019996
Energy: 1.4238707411601719
Energy: 1.3961335761835216
Energy: 1.4859996500993322
Energy: 1.3433823169874628
Energy: 1.4035316549089314
Energy: 1.387143242523763
Energy: 1.3433823169927979
Energy: 1.4035316549115988
Energy: 1.387143242523763
Energy: 1.3433823169927979
Energy: 1.4035316549142665
Energy: 1.3871432425210954
Energy: 1.3433823169874628
Energy: 1.3429861598902124
Energy: 1.432790436619851
Energy: 1.3876256013047454
Energy: 1.342986159887545
Energy: 1.4327904366225181
Energy: 1.3876256013047454
Energy: 1.3429861598848776
Energy: 1.4327904366171835
Energy: 1.3876256013074129
Energy: 1.3429861598848776
Energy: 1.415605814208728
Energy: 1.3847826463987432
Energy: 1.3627595045878464
Energy: 1.415605814208728
Energy: 1.3847826463960755
Energy: 1.362460128096262
Energy: 1.4156058142060604
Energy: 1.3847826464014106
Energy: 1.362759504579844
Energy: 1.415605814208728
Energy: 1.4331601105043295
Energy: 1.5371297077054065
Energy: 1.3549117113814553
Energy: 1.4331601105017104
Energy: 1.537129707697404
Energy: 1.3549117113761202
Energy: 1.433160110499043
Energy: 1.537129707692069
Energy: 1.3549117113814553
Energy: 1.4331601105017104

minimum gb energy = 1.3397100192580844 eV
minimum distance =  2.22953998081532 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.357993730204676
Energy: 1.3592076833599023
Energy: 1.359365020043136
Energy: 1.357993730204194
Energy: 1.3592076833584559
Energy: 1.3593650200421716
Energy: 1.357993730204676
Energy: 1.3592076833565274
Energy: 1.3593650200445824
Energy: 1.357993730203712
Energy: 1.3567520736907543
Energy: 1.3584840565553802
Energy: 1.3587383788061969
Energy: 1.3567520736941294
Energy: 1.358484056554416
Energy: 1.358738378806679
Energy: 1.3567520736912366
Energy: 1.3584840565553802
Energy: 1.3587383788057146
Energy: 1.3567520736922007
Energy: 1.3572037789344564
Energy: 1.3573798656442373
Energy: 1.4945749489043625
Energy: 1.3572037789363847
Energy: 1.357379865643273
Energy: 1.4945749487583686
Energy: 1.3572037789344564
Energy: 1.3573798656442373
Energy: 1.4945749487819486
Energy: 1.3572037789363847
Energy: 1.494590947577972
Energy: 1.3574667183482727
Energy: 1.3572267715574442
Energy: 1.4945909475702581
Energy: 1.3574667183487548
Energy: 1.3572267715588908
Energy: 1.4945909475673653
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Energy: 1.3572267715574442
Energy: 1.494590947574597
Energy: 1.3589160316693563
Energy: 1.358289662593317
Energy: 1.3566322082105216
Energy: 1.3589160316708027
Energy: 1.3582896625957275
Energy: 1.3566322082133706
Energy: 1.3589160316688742
Energy: 1.358289662593317
Energy: 1.3566322082114857
Energy: 1.3589160316703206
Energy: 1.3592076833565274
Energy: 1.359365020042654
Energy: 1.357993730204194
Energy: 1.3592076833574918
Energy: 1.359365020038315
Energy: 1.357993730204194
Energy: 1.3592076833565274
Energy: 1.3593650200421716
Energy: 1.357993730204676
Energy: 1.359207683354599
Energy: 1.3584840565558622
Energy: 1.3587383788018577
Energy: 1.3567520736907543
Energy: 1.3584840565558622
Energy: 1.3587383788047505
Energy: 1.3567520736912366
Energy: 1.3584840565553802
Energy: 1.3587383788028218
Energy: 1.3567520736907543
Energy: 1.3584840565548981
Energy: 1.357379865642791
Energy: 1.4945749492513551
Energy: 1.3572037789339741
Energy: 1.3573798656452014
Energy: 1.494574949156422
Energy: 1.3572037789363847
Energy: 1.3573798656423088
Energy: 1.4945749492474982
Energy: 1.3572037789339741
Energy: 1.357379865643755
Energy: 1.3574667183506832
Energy: 1.3572267715584085
Energy: 1.4945909475678474
Energy: 1.3574667183521296
Energy: 1.3572267715574442
Energy: 1.4945909475606158
Energy: 1.3574667183482727
Energy: 1.3572267715588908
Energy: 1.494590947569776
Energy: 1.3574667183429694
Energy: 1.3582896625957275
Energy: 1.3566322082095574
Energy: 1.3589160316654991
Energy: 1.358289662593317
Energy: 1.3566322082128885
Energy: 1.3589160316688742
Energy: 1.3582896625957275
Energy: 1.3566322082133706
Energy: 1.358916031668392
Energy: 1.358289662593317
Energy: 1.3593650200378329
Energy: 1.357993730203712
Energy: 1.3592076833589382
Energy: 1.359365020042654
Energy: 1.3579937302051583
Energy: 1.3592076833594202
Energy: 1.3593650200412073
Energy: 1.357993730203712
Energy: 1.3592076833570095
Energy: 1.3593650200421716
Energy: 1.3587383788061969
Energy: 1.356752073693165
Energy: 1.3584840565548981
Energy: 1.358738378806679
Energy: 1.3567520736912366
Energy: 1.3584840565553802
Energy: 1.3587383788028218
Energy: 1.3567520736917187
Energy: 1.3584840565548981
Energy: 1.358738378803304
Energy: 1.494574948857641
Energy: 1.3572037789363847
Energy: 1.357379865643755
Energy: 1.4945749489299147
Energy: 1.3572037789344564
Energy: 1.3573798656442373
Energy: 1.4945749493636007
Energy: 1.3572037789363847
Energy: 1.357379865643755
Energy: 1.494574948959806
Energy: 1.3572267715569621
Energy: 1.4945909475750794
Energy: 1.3574667183482727
Energy: 1.3572267715584085
Energy: 1.4945909475654369
Energy: 1.3574667183463442
Energy: 1.3572267715574442
Energy: 1.4945909475673653
Energy: 1.35746671834538
Energy: 1.3572267715584085
Energy: 1.3566322082114857
Energy: 1.3589160316703206
Energy: 1.3582896625957275
Energy: 1.3566322082177094
Energy: 1.3589160316679099
Energy: 1.358289662593317
Energy: 1.3566322082100395
Energy: 1.3589160316669455
Energy: 1.3582896625962095
Energy: 1.3566322082105216
Energy: 1.357993730204676
Energy: 1.3592076833574918
Energy: 1.3593650200450644
Energy: 1.3579937302032297
Energy: 1.3592076833550812
Energy: 1.3593650200397611
Energy: 1.357993730204194
Energy: 1.3592076833570095
Energy: 1.3593650200397611
Energy: 1.357993730203712
Energy: 1.3567520736907543
Energy: 1.3584840565548981
Energy: 1.3587383788037861
Energy: 1.356752073692683
Energy: 1.3584840565548981
Energy: 1.3587383788047505
Energy: 1.356752073692683
Energy: 1.3584840565553802
Energy: 1.3587383788042682
Energy: 1.3567520736922007
Energy: 1.3572037789344564
Energy: 1.3573798656442373
Energy: 1.4945749490185802
Energy: 1.3572037789363847
Energy: 1.357379865642791
Energy: 1.4945749489751898
Energy: 1.3572037789339741
Energy: 1.3573798656452014
Energy: 1.4945749490937468
Energy: 1.3572037789359026
Energy: 1.4945909475543482
Energy: 1.3574667183473084
Energy: 1.3572267715574442
Energy: 1.4945909475543482
Energy: 1.3574667183473084
Energy: 1.3572267715584085
Energy: 1.4945909475456702
Energy: 1.3574667183477906
Energy: 1.3572267715574442
Energy: 1.4945909475586872
Energy: 1.3589160316708027
Energy: 1.358289662593317
Energy: 1.356632208215781
Energy: 1.3589160316659812
Energy: 1.3582896625962095
Energy: 1.3566322082114857
Energy: 1.3589160316698383
Energy: 1.358289662593317
Energy: 1.3566322082138527
Energy: 1.3589160316688742
Energy: 1.3592076833579738
Energy: 1.3593650200412073
Energy: 1.3579937302051583
Energy: 1.3592076833565274
Energy: 1.3593650200421716
Energy: 1.357993730204676
Energy: 1.3592076833584559
Energy: 1.3593650200416896
Energy: 1.357993730204676
Energy: 1.3592076833565274
Energy: 1.3584840565548981
Energy: 1.3587383788052325
Energy: 1.356752073693165
Energy: 1.3584840565548981
Energy: 1.3587383788013756
Energy: 1.3567520736912366
Energy: 1.3584840565553802
Energy: 1.3587383788057146
Energy: 1.3567520736897902
Energy: 1.3584840565548981

minimum gb energy = 1.3566322082095574 eV
minimum distance =  2.28595747615895 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.4278798837208853
Energy: 1.4198427853369155
Energy: 1.4206527762754324
Energy: 1.3834737915429078
Energy: 1.4198427853303592
Energy: 1.4206527762819887
Energy: 1.4278798837230309
Energy: 1.4198427853303592
Energy: 1.420652776284174
Energy: 1.3834737915429078
Energy: 1.3525545981460867
Energy: 1.353847384606615
Energy: 1.3339045116173738
Energy: 1.3525545981417157
Energy: 1.353847384602244
Energy: 1.3339045116173738
Energy: 1.3525545981417157
Energy: 1.353847384606615
Energy: 1.3339045116151884
Energy: 1.352554598143901
Energy: 1.3918333053747343
Energy: 1.4141761077703794
Energy: 1.430481792903772
Energy: 1.3918333053659924
Energy: 1.4141761077725647
Energy: 1.4304817929016262
Energy: 1.3918333053703633
Energy: 1.4141761077660087
Energy: 1.430481792903772
Energy: 1.3918333053747343
Energy: 1.324346496101224
Energy: 1.4137523664310923
Energy: 1.3209279207081768
Energy: 1.3243464960968532
Energy: 1.4137523664376486
Energy: 1.3209279207059914
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Energy: 1.3209279207081768
Energy: 1.3243464961055949
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Energy: 1.3536937493255552
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Energy: 1.3320196172046654
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Energy: 1.4420679981189866
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Energy: 1.3892480482906098
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Energy: 1.3212509311954848
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Energy: 1.3892480482906098
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Energy: 1.4187581223898709
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Energy: 1.3548580025298336
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Energy: 1.3852754209377702
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Energy: 1.3630348404168413
Energy: 1.3622298175210703
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Energy: 1.3852754209421412
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Energy: 1.3109284410724882
Energy: 1.3464324047210519
Energy: 1.3421815797672623
Energy: 1.3661307003221697
Energy: 1.3464309559994634
Energy: 1.3421815797716332
Energy: 1.3636364463520525
Energy: 1.346432404734125
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Energy: 1.366130700317799
Energy: 1.346430956001649
Energy: 1.4432736031606042
Energy: 1.3087418055279187
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Energy: 1.4432736031584186
Energy: 1.3087418055322895
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Energy: 1.4432736031693458
Energy: 1.4503300373657992
Energy: 1.3195537638392618
Energy: 1.5898957297047356
Energy: 1.4503300373657992
Energy: 1.319603187357238
Energy: 1.5898957297047356
Energy: 1.4503300373679848
Energy: 1.319553763837076
Energy: 1.5898957297047356
Energy: 1.4503300373679848
Energy: 1.4543349378319705
Energy: 1.318442511881434
Energy: 1.3993308610977562
Energy: 1.4543349378341563
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Energy: 1.4543349378297854
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Energy: 1.4543349378341563
Energy: 1.322969715171895
Energy: 1.3221911228016008
Energy: 1.561805959444508
Energy: 1.322969715171895
Energy: 1.322191122808157
Energy: 1.5618059594423221
Energy: 1.3229697151762658
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Energy: 1.561805959440137
Energy: 1.3229697151697493
Energy: 1.431833315618916
Energy: 1.4824379405888264
Energy: 1.3364060596795018
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Energy: 1.4824379405844554
Energy: 1.3363677819606015
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Energy: 1.48243794058227
Energy: 1.3364060596816874
Energy: 1.431833315623287
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Energy: 1.3469024004955512
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Energy: 1.3469024004911803
Energy: 1.5012977714696254
Energy: 1.333795182749924
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Energy: 1.5012977714739961
Energy: 1.3337951827564802
Energy: 1.3936778881070022
Energy: 1.4447367425179858
Energy: 1.4390952560357966
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Energy: 1.3355293340143581
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Energy: 1.3455609370162487
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Energy: 1.3953816220380673
Energy: 1.3541535325670733
Energy: 1.5197370255487275
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Energy: 1.3541535325670733
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Energy: 1.3953816220380673
Energy: 1.354153532564888
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Energy: 1.4067884696436959
Energy: 1.4779630826547387
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Energy: 1.4067884696328081
Energy: 1.477963082661295
Energy: 1.3223235458733398
Energy: 1.4067884696349542
Energy: 1.4151419620933352
Energy: 1.3751647583246938
Energy: 1.420858865500078
Energy: 1.4147405825278097
Energy: 1.3752844727772238
Energy: 1.420858865500078
Energy: 1.415141962086779
Energy: 1.37516475833125
Energy: 1.4208588654957073
Energy: 1.4147405825212536
Energy: 1.3297239397721905
Energy: 1.385654115541577
Energy: 1.3055612886028056
Energy: 1.3297239397700051
Energy: 1.3856541155437623
Energy: 1.305561288604991
Energy: 1.3297239397700051
Energy: 1.3856541155481332
Energy: 1.3055612886028056
Energy: 1.3297239397765612
Energy: 1.402771614065987
Energy: 1.3896350597435818
Energy: 1.4309020123449243
Energy: 1.4027716140703579
Energy: 1.3896350597435818
Energy: 1.430902012338368
Energy: 1.4027716140746889
Energy: 1.3896350597435818
Energy: 1.4309020123361826
Energy: 1.4027716140725432
Energy: 1.346836528149225
Energy: 1.4391204056525972
Energy: 1.3317070208607793
Energy: 1.3468451422532621
Energy: 1.4391204056482263
Energy: 1.409606313926376
Energy: 1.3468365281448542
Energy: 1.4391204056460407
Energy: 1.3317070208651502
Energy: 1.3468451422510765
Energy: 1.4648611385910646
Energy: 1.303551453989882
Energy: 1.4314163655153778
Energy: 1.4648611385866939
Energy: 1.3035514539833257
Energy: 1.4314163655131924
Energy: 1.4648611385932502
Energy: 1.3035514539920674
Energy: 1.4314163655197487
Energy: 1.464861138588879
Energy: 1.4740245890040893
Energy: 1.4873386015280172
Energy: 1.5980416996085751
Energy: 1.4740245890040893
Energy: 1.4873386015193153
Energy: 1.5980416996085751
Energy: 1.4740245890062749
Energy: 1.4873386015215007
Energy: 1.5980416996085751
Energy: 1.4740245890040893
Energy: 1.4030258114466967
Energy: 1.3181118376480208
Energy: 1.3744010779241522
Energy: 1.401685162594738
Energy: 1.3177900252608916
Energy: 1.3744010779241522
Energy: 1.403025811442326
Energy: 1.3181118376480208
Energy: 1.3744010779285232
Energy: 1.4016851625925522
Energy: 1.3440717955639012
Energy: 1.3192537547844976
Energy: 1.4008669869824288
Energy: 1.3440717955660866
Energy: 1.3192537547801269
Energy: 1.4008669869824288
Energy: 1.3440717955551593
Energy: 1.3192537547801269
Energy: 1.4008669869802433
Energy: 1.3440717955660866
Energy: 1.4384277511045915
Energy: 1.4159382647771657
Energy: 1.339149094695146
Energy: 1.438427751106777
Energy: 1.4159382647706091
Energy: 1.3391483969006357
Energy: 1.4384277511024062
Energy: 1.4159382647727947
Energy: 1.3391490946885898
Energy: 1.4384277511111478
Energy: 1.3059758400433261
Energy: 1.4363185212223746
Energy: 1.4994474878828656
Energy: 1.305975840047697
Energy: 1.4363185212180036
Energy: 1.4994474878850512
Energy: 1.3059758400411408
Energy: 1.43631852122456
Energy: 1.49944748788072
Energy: 1.30597584003677
Energy: 1.4272730970793468
Energy: 1.5026735441638905
Energy: 1.3917668770073932
Energy: 1.3836117357578015
Energy: 1.5026735441529635
Energy: 1.3917668770095788
Energy: 1.4272730970793468
Energy: 1.5026735441529635
Energy: 1.3917668770139497
Energy: 1.3836117357534305
Energy: 1.4267159880999856
Energy: 1.4132113512780506
Energy: 1.4808407140764455
Energy: 1.3829133307837527
Energy: 1.413211351280236
Energy: 1.4859045719505084
Energy: 1.4267159880978004
Energy: 1.413211351286792
Energy: 1.4808407140808162
Energy: 1.3829133307859383
Energy: 1.3074146070125345
Energy: 1.4372319960990185
Energy: 1.3414384127235053
Energy: 1.3074146070081636
Energy: 1.437231996101204
Energy: 1.3414384127235053
Energy: 1.307414607010349
Energy: 1.4372319960968332
Energy: 1.3414384127235053
Energy: 1.3074146070059782
Energy: 1.382519919759925
Energy: 1.3406742612155302
Energy: 1.4475311616185598
Energy: 1.3825199197577391
Energy: 1.3406742612220865
Energy: 1.4475311616251163
Energy: 1.3825199197577391
Energy: 1.3406742612220865
Energy: 1.4475311616185598
Energy: 1.3825199197642957
Energy: 1.344828050259429
Energy: 1.5008532045839427
Energy: 1.3171004058140008
Energy: 1.3448280502616143
Energy: 1.5008532045839427
Energy: 1.3163691290077821
Energy: 1.3448280502550582
Energy: 1.5008532045861283
Energy: 1.3171004058074443
Energy: 1.3448280502550582
Energy: 1.551165245516011
Energy: 1.4118354383984202
Energy: 1.3191144999691442
Energy: 1.551165245520382
Energy: 1.4118354384049767
Energy: 1.3191144999604025
Energy: 1.551165245516011
Energy: 1.4118354384071623
Energy: 1.319114499962588
Energy: 1.551165245516011
Energy: 1.3205447727530526
Energy: 1.5103137360581749
Energy: 1.3395452193476132
Energy: 1.320544772750867
Energy: 1.5103137360516183
Energy: 1.3395452193541693
Energy: 1.320544772750867
Energy: 1.5103137360450622
Energy: 1.3395452193519837
Energy: 1.3205447727464963
Energy: 1.312163312942664
Energy: 1.4037585337575538
Energy: 1.3054935533114114
Energy: 1.312163312938293
Energy: 1.403758533753183
Energy: 1.3054935533070406
Energy: 1.312163312938293
Energy: 1.4037585337488123
Energy: 1.30549355330267
Energy: 1.3121633129361077
Energy: 1.3475319823465886
Energy: 1.4180974647053899
Energy: 1.441361386258056
Energy: 1.347531982348774
Energy: 1.4180974646988336
Energy: 1.441361386262427
Energy: 1.3475319823509595
Energy: 1.4180974646988336
Energy: 1.4413613862646124
Energy: 1.347531982348774
Energy: 1.4990846964375357
Energy: 1.3896691650535236
Energy: 1.3885644824852104
Energy: 1.4990846964375357
Energy: 1.3681864006698858
Energy: 1.3672622961830896
Energy: 1.4990846964375357
Energy: 1.3896691650557087
Energy: 1.3885644824808394
Energy: 1.499084696444092
Energy: 1.333538335961767
Energy: 1.3059299267046225
Energy: 1.4390893837228198
Energy: 1.333538335963952
Energy: 1.3059299267089934
Energy: 1.4390893837206342
Energy: 1.333538335968323
Energy: 1.3059299267046225
Energy: 1.4390893837206342
Energy: 1.333538335963952
Energy: 1.4145601777983123
Energy: 1.484446834726285
Energy: 1.4143771228910245
Energy: 1.4145601777983123
Energy: 1.4844468347153577
Energy: 1.4143771228997664
Energy: 1.4145601777983123
Energy: 1.4844468347240993
Energy: 1.4143771228997664
Energy: 1.4145601778004977
Energy: 1.4304404994700548
Energy: 1.3182921072993794
Energy: 1.4098427757699734
Energy: 1.4304404994678692
Energy: 1.318292428342597
Energy: 1.4098427757656025
Energy: 1.4304404994634985
Energy: 1.318292107292823
Energy: 1.4098427757743444
Energy: 1.430440499465684
Energy: 1.3461676412854617
Energy: 1.3401302785135158
Energy: 1.4987606365883455
Energy: 1.3461676412876469
Energy: 1.3401302785135158
Energy: 1.4987606365905308
Energy: 1.3461676412898325
Energy: 1.3401302785113305
Energy: 1.4987606365970871
Energy: 1.3461676412898325
Energy: 1.347069982550209
Energy: 1.396233523502233
Energy: 1.3369818427093634
Energy: 1.3470699825436527
Energy: 1.396233523502233
Energy: 1.336979694087465
Energy: 1.3470699825458383
Energy: 1.3962335235000478
Energy: 1.3369818427093634
Energy: 1.3470699825458383
Energy: 1.3049933797158653
Energy: 1.3683228395717262
Energy: 1.3145910976827806
Energy: 1.3049933797114943
Energy: 1.3683228395739115
Energy: 1.3145910976871515
Energy: 1.3049933797224216
Energy: 1.3683228395717262
Energy: 1.3145910976849662
Energy: 1.304993379720236
Energy: 1.3838239847111002
Energy: 1.5028535443230242
Energy: 1.3204279945155803
Energy: 1.3832688155041846
Energy: 1.5028535443186533
Energy: 1.3204279945090238
Energy: 1.3838239847132858
Energy: 1.502853544320839
Energy: 1.3204279945112094
Energy: 1.3832688155085555

minimum gb energy = 1.3035514539833257 eV
minimum distance =  2.21886904953535 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.265746545279581
Energy: 1.2861454461133688
Energy: 1.2739818850725775
Energy: 1.2657465452779888
Energy: 1.2861454461117763
Energy: 1.2739818850701887
Energy: 1.2657465452803773
Energy: 1.2861454461133688
Energy: 1.2739818850733735
Energy: 1.2657465452779888
Energy: 1.3466690929594842
Energy: 1.2429188773886712
Energy: 1.2586983160418843
Energy: 1.3466690929610763
Energy: 1.2429188773870787
Energy: 1.2586983160426808
Energy: 1.3466690929642613
Energy: 1.2429188773886712
Energy: 1.2586983160418843
Energy: 1.3466690929610763
Energy: 1.4055071670674872
Energy: 1.2306606246380698
Energy: 1.5355522662753118
Energy: 1.4055071670698758
Energy: 1.2306606246364773
Energy: 1.5355558950439587
Energy: 1.4055071670674872
Energy: 1.2306606246372733
Energy: 1.5355506899455247
Energy: 1.4055071670698758
Energy: 1.289627046194113
Energy: 1.4078520864634707
Energy: 1.2932996302495714
Energy: 1.2896270461957056
Energy: 1.4078520864626747
Energy: 1.293299630251164
Energy: 1.2896270461949093
Energy: 1.4078520864634707
Energy: 1.2932996302495714
Energy: 1.2896270461957056
Energy: 1.2922615786735905
Energy: 1.2553864068224263
Energy: 1.4392256294141472
Energy: 1.2922615786759788
Energy: 1.2553864068200375
Energy: 1.4392256294141472
Energy: 1.2922615786743865
Energy: 1.2553864068224263
Energy: 1.4392256294149437
Energy: 1.2922615786759788
Energy: 1.2916914100181967
Energy: 1.3398628487410336
Energy: 1.2429111608925967
Energy: 1.2916914100158083
Energy: 1.3398628487418298
Energy: 1.2429111608925967
Energy: 1.2916914100181967
Energy: 1.3398628487410336
Energy: 1.2429111608925967
Energy: 1.2916914100158083
Energy: 1.375088217755503
Energy: 1.3474483299690976
Energy: 1.2306386476348492
Energy: 1.3750882177547068
Energy: 1.276825269275542
Energy: 1.2306386476364417
Energy: 1.3007517017585706
Energy: 1.276825269275542
Energy: 1.2306386476356452
Energy: 1.3007517017593664
Energy: 1.272860434430308
Energy: 1.4694326018596076
Energy: 1.254284842179398
Energy: 1.2728604344247345
Energy: 1.4694326018588113
Energy: 1.2542848421770096
Energy: 1.2728604344334928
Energy: 1.4694326018588113
Energy: 1.2542848421762134
Energy: 1.272860434426327
Energy: 1.5358214876792777
Energy: 1.2551161754774214
Energy: 1.255406140407554
Energy: 1.535821487675297
Energy: 1.2551161754766251
Energy: 1.2554061404059618
Energy: 1.5358214876792777
Energy: 1.2551161754774214
Energy: 1.255406140407554
Energy: 1.535821487676093
Energy: 1.377825383219153
Energy: 1.2917557183740818
Energy: 1.3966814125663092
Energy: 1.3778253832175607
Energy: 1.2917557183724893
Energy: 1.3966814021854415
Energy: 1.377825383219153
Energy: 1.2917557183740818
Energy: 1.3966814061255675
Energy: 1.3778253832175607
Energy: 1.3640879280939955
Energy: 1.3626929559610863
Energy: 1.2893670636056036
Energy: 1.3640879280947917
Energy: 1.3626929559626784
Energy: 1.2893670636032148
Energy: 1.3640879280955878
Energy: 1.3626929559610863
Energy: 1.2893670636063996
Energy: 1.3640879280955878
Energy: 1.2916453783329545
Energy: 1.2463502299402467
Energy: 1.2466585457278199
Energy: 1.2916453783329545
Energy: 1.246350229941043
Energy: 1.2466585457262274
Energy: 1.2916453783329545
Energy: 1.2463502299394504
Energy: 1.2466585457278199
Energy: 1.2916453783321582
Energy: 1.255077921149801
Energy: 1.5076057155217295
Energy: 1.2555370492076328
Energy: 1.2550779211505971
Energy: 1.5076057155225258
Energy: 1.2555370492076328
Energy: 1.255077921149801
Energy: 1.507605715520137
Energy: 1.2555370492076328
Energy: 1.2550779211505971
Energy: 1.268449630478969
Energy: 1.2665328264180082
Energy: 1.2926719556728246
Energy: 1.2684496304757844
Energy: 1.266532826421193
Energy: 1.292671955674417
Energy: 1.268449630478969
Energy: 1.2665328264180082
Energy: 1.2926719556720283
Energy: 1.268449630477377

minimum gb energy = 1.2306386476348492 eV
minimum distance =  2.25017469828453 Angstroms
sigma value = 33